[1-[4-[(E)-2-(4-methylsulfonylphenyl)ethenyl]phenyl]piperidin-4-yl] prop-2-enoate

Systemtic Name: [1-[4-[(E)-2-(4-methylsulfonylphenyl)ethenyl]phenyl]piperidin-4-yl] prop-2-enoate Openeye Name: [1-[4-[(E)-2-(4-methylsulfonylphenyl)vinyl]phenyl]-4-piperidyl] prop-2-enoate CAS Name: 2-propenoic acid [1-[4-[(E)-2-(4-methylsulfonylphenyl)ethenyl]phenyl]-4-piperidinyl] ester IUPAC Name: [1-[4-[(E)-2-(4-methylsulfonylphenyl)ethenyl]phenyl]piperidin-4-yl] prop-2-enoate Traditional Name: acrylic acid [1-[4-[(E)-2-(4-mesylphenyl)vinyl]phenyl]-4-piperidyl] ester Formula: C23H25NO4S MolecularWeight: 411.5139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)N3CCC(CC3)OC(=O)C=C

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)N3CCC(CC3)OC(=O)C=C

InChI

InChI=1S/C23H25NO4S/c1-3-23(25)28-21-14-16-24(17-15-21)20-10-6-18(7-11-20)4-5-19-8-12-22(13-9-19)29(2,26)27/h3-13,21H,1,14-17H2,2H3/b5-4+